N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide

C21H23NO2S2 — CID 30943313

IUPACN-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide
SMILESO=S(=O)(NCC1(c2cccs2)CCCCC1)c1cccc2ccccc12
InChIInChI=1S/C21H23NO2S2/c23-26(24,19-11-6-9-17-8-2-3-10-18(17)19)22-16-21(13-4-1-5-14-21)20-12-7-15-25-20/h2-3,6-12,15,22H,1,4-5,13-14,16H2
InChIKeyMZZJRLNLDHIEHR-UHFFFAOYSA-N
MW385.55 g/mol
LogP5.08
Rot. Bonds5

About N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide

N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide (PubChem CID 30943313) has the molecular formula C21H23NO2S2 and a molecular weight of 385.55 g/mol. Its IUPAC name is N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide
PubChem CID30943313
Molecular FormulaC21H23NO2S2
Molecular Weight385.55 g/mol
Exact Mass385.12
IUPAC NameN-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide
SMILESO=S(=O)(NCC1(c2cccs2)CCCCC1)c1cccc2ccccc12
InChIInChI=1S/C21H23NO2S2/c23-26(24,19-11-6-9-17-8-2-3-10-18(17)19)22-16-21(13-4-1-5-14-21)20-12-7-15-25-20/h2-3,6-12,15,22H,1,4-5,13-14,16H2
InChIKeyMZZJRLNLDHIEHR-UHFFFAOYSA-N
XLogP5.08
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.55
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3,4,5,6-pentamethyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943352
2-cyano-N-[(1-thiophen-2-ylcyclopropyl)methyl]benzenesulfonamide
CID 110731431
2,3,5,6-tetramethyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943321
2,4-dimethoxy-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943344
4-methoxy-2-methyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943293
2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide
CID 30943250
2-fluoro-N-[(4-thiophen-2-yloxan-4-yl)methyl]benzenesulfonamide
CID 30944278
N-[4-[(1-thiophen-2-ylcyclohexyl)methylsulfamoyl]phenyl]acetamide
CID 30943323
2,4-dimethyl-N-[(1-thiophen-2-ylcyclopropyl)methyl]benzenesulfonamide
CID 30530525
1-(4-chlorophenyl)-N-[(1-thiophen-2-ylcyclohexyl)methyl]methanesulfonamide
CID 30943309
methyl N-[4-[(1-thiophen-2-ylcyclopentyl)methylsulfamoyl]phenyl]carbamate
CID 71806721
N-[(1-thiophen-2-ylcyclohexyl)methyl]cyclopropanamine
CID 62595162

Frequently Asked Questions

What is the IUPAC name of N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide?
The IUPAC name of N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide (CID 30943313) is N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide.
What is the SMILES notation for N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide?
The canonical SMILES for N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide is O=S(=O)(NCC1(c2cccs2)CCCCC1)c1cccc2ccccc12.
What is the InChIKey of N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide?
The InChIKey is MZZJRLNLDHIEHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO2S2/c23-26(24,19-11-6-9-17-8-2-3-10-18(17)19)22-16-21(13-4-1-5-14-21)20-12-7-15-25-20/h2-3,6-12,15,22H,1,4-5,13-14,16H2.
What are the key properties of N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide?
N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide has a molecular weight of 385.55 g/mol, XLogP of 5.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide is sourced from PubChem (CID 30943313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).